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16-BROMO-3,6,9,12-TETRAOXA-18-AZABICYCLO-[12.3.1]-OCTADECA-1(18),14,16-TRIENE
SpectraBase Compound ID 6dBZBBrzhfe
InChI InChI=1S/C13H18BrNO4/c14-11-7-12-9-18-5-3-16-1-2-17-4-6-19-10-13(8-11)15-12/h7-8H,1-6,9-10H2
InChIKey HZGOKLHVJSLFHW-UHFFFAOYSA-N
Mol Weight 332.19 g/mol
Molecular Formula C13H18BrNO4
Exact Mass 331.041921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ib6o0nPS06o
Name 16-bromanyl-3,6,9,12-tetraoxa-18-azabicyclo[12.3.1]octadeca-1(17),14(18),15-triene
Alternate Name(s) 16-bromo-3,6,9,12-tetraoxa-18-azabicyclo[12.3.1]octadeca-1(17),14(18),15-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18BrNO4
InChI InChI=1S/C13H18BrNO4/c14-11-7-12-9-18-5-3-16-1-2-17-4-6-19-10-13(8-11)15-12/h7-8H,1-6,9-10H2
InChIKey HZGOKLHVJSLFHW-UHFFFAOYSA-N
Molecular Weight 332.194 g/mol
SMILES c12nc(cc(c2)Br)COCCOCCOCCOC1
SPLASH splash10-0f8c-0193000000-f6683467b2d0196f95d1
Source of Spectrum KC-0-1746-8
Wiley ID 828289